⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL9735358 | 0.83 | APEX1 (0.36) | — | |
| SCHEMBL28298382 | 0.81 | EPHX1 (0.32) | — | |
| SCHEMBL19198393 | 0.73 | — | — | |
| SCHEMBL28227607 | 0.73 | EPHX1 (0.32) | — | |
| SCHEMBL7190384 | 0.72 | CES2 (0.46) | — | |
| SCHEMBL19137660 | 0.71 | MTNR1A (0.32) | — | |
| SCHEMBL19137659 | 0.71 | MTNR1A (0.32) | — | |
| SCHEMBL23073940 | 0.70 | — | — | |
| SCHEMBL19163876 | 0.70 | — | — | |
| SCHEMBL1067333 | 0.69 | HTT (0.30) | — |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9549560-B2 | Pesticidal compositions and related methods | DOW AGROSCIENCES LLC (US) | 2017-01-24 | — | — | US | disclosed |
| US-9549560-B2 | Pesticidal compositions and related methods | DOW AGROSCIENCES LLC (US) | 2017-01-24 | — | — | US | disclosed |
| US-9549560-B2 | Pesticidal compositions and related methods | DOW AGROSCIENCES LLC (US) | 2017-01-24 | — | — | US | disclosed |
| EP-3060046-A1 | PESTICIDAL COMPOSITIONS AND RELATED METHODS | Dow AgroSciences LLC (US) | 2016-08-31 | — | — | EP | disclosed |
| CN-105792651-A | Pesticidal compositions and related methods | 美国陶氏益农公司 | 2016-07-20 | — | — | CN | disclosed |
| WO-2015061161-A1 | PESTICIDAL COMPOSITIONS AND RELATED METHODS | DOW AGROSCIENCES LLC (US) | 2015-04-30 | — | — | WO | disclosed |
| WO-2015061161-A1 | PESTICIDAL COMPOSITIONS AND RELATED METHODS | DOW AGROSCIENCES LLC (US) | 2015-04-30 | — | — | WO | disclosed |
| US-20150111733-A1 | PESTICIDAL COMPOSITIONS AND RELATED METHODS | DOW AGROSCIENCES LLC | 2015-04-23 | — | — | US | disclosed |
| US-20150111733-A1 | PESTICIDAL COMPOSITIONS AND RELATED METHODS | DOW AGROSCIENCES LLC | 2015-04-23 | — | — | US | disclosed |
| US-20150111733-A1 | PESTICIDAL COMPOSITIONS AND RELATED METHODS | DOW AGROSCIENCES LLC | 2015-04-23 | — | — | US | disclosed |